3-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-6-fluoranyl-quinazolin-4-one

Systemtic Name: 3-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-6-fluoranyl-quinazolin-4-one Openeye Name: 3-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-oxo-ethyl]-6-fluoro-quinazolin-4-one CAS Name: 3-[2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-6-fluoro-4-quinazolinone IUPAC Name: 3-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-oxoethyl]-6-fluoroquinazolin-4-one Traditional Name: 3-[2-[4-(4-chlorobenzoyl)piperazino]-2-keto-ethyl]-6-fluoro-quinazolin-4-one Formula: C21H18ClFN4O3 MolecularWeight: 428.844023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClFN4O3/c22-15-3-1-14(2-4-15)20(29)26-9-7-25(8-10-26)19(28)12-27-13-24-18-6-5-16(23)11-17(18)21(27)30/h1-6,11,13H,7-10,12H2